Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1OC(=O)C(CSC1=NC3=CC(Cl)=C(Cl)C=C3N1[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)=C2

InChIKey

InChIKey=WGDAGSUUOOXCHC-LXRLAABLSA-N

Formula

C32H30Cl2N2O12S

Mass

737.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

1-pyranosylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

1-pyranosylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-pyranosylbenzimidazole - Tetracarboxylic acid or derivatives - N-glycosyl compound - Glycosyl compound - Coumarin - 1-benzopyran - Benzopyran - Benzimidazole - Aryl thioether - Anisole - Alkylarylthioether - Pyranone - Alkyl aryl ether - Benzenoid - Pyran - Oxane - N-substituted imidazole - Monosaccharide - Aryl halide - Aryl chloride - Heteroaromatic compound - Imidazole - Azole - Lactone - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-pyranosylbenzimidazoles. These are nucleoside and nucleotide analogs with a structure that consists of a Benzimidazole which is N-substituted at the 1-position with a pyranose moiety. Nucleotide analogues contain a phosphate group linked to the C5 carbon atom of the pyranose.

External Descriptors

Not available

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